N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide

C38H74N6O18 — CID 123667701

IUPACN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide
SMILESCNCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(C)O
InChIInChI=1S/C38H74N6O18/c1-33(45)27-57-21-15-52-10-4-40-35(47)29-59-23-17-54-12-6-42-37(49)31-61-25-19-56-14-8-44-38(50)32-62-26-20-55-13-7-43-36(48)30-60-24-18-53-11-5-41-34(46)28-58-22-16-51-9-3-39-2/h33,39,45H,3-32H2,1-2H3,(H,40,47)(H,41,46)(H,42,49)(H,43,48)(H,44,50)
InChIKeyWHDPHSWGVZUMIY-UHFFFAOYSA-N
MW903.03 g/mol
LogP-4.63
Rot. Bonds48

About N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide

N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide (PubChem CID 123667701) has the molecular formula C38H74N6O18 and a molecular weight of 903.03 g/mol. Its IUPAC name is N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide.

Molecular Properties

Compound NameN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide
PubChem CID123667701
Molecular FormulaC38H74N6O18
Molecular Weight903.03 g/mol
Exact Mass902.51
IUPAC NameN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide
SMILESCNCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(C)O
InChIInChI=1S/C38H74N6O18/c1-33(45)27-57-21-15-52-10-4-40-35(47)29-59-23-17-54-12-6-42-37(49)31-61-25-19-56-14-8-44-38(50)32-62-26-20-55-13-7-43-36(48)30-60-24-18-53-11-5-41-34(46)28-58-22-16-51-9-3-39-2/h33,39,45H,3-32H2,1-2H3,(H,40,47)(H,41,46)(H,42,49)(H,43,48)(H,44,50)
InChIKeyWHDPHSWGVZUMIY-UHFFFAOYSA-N
XLogP-4.63
TPSA288.52 Ų
H-Bond Donors7
H-Bond Acceptors19
Rotatable Bonds48
Heavy Atoms62
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500903.03
LogP ≤ 5-4.63
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide?
The IUPAC name of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide (CID 123667701) is N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide.
What is the SMILES notation for N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide?
The canonical SMILES for N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide is CNCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(C)O.
What is the InChIKey of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide?
The InChIKey is WHDPHSWGVZUMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H74N6O18/c1-33(45)27-57-21-15-52-10-4-40-35(47)29-59-23-17-54-12-6-42-37(49)31-61-25-19-56-14-8-44-38(50)32-62-26-20-55-13-7-43-36(48)30-60-24-18-53-11-5-41-34(46)28-58-22-16-51-9-3-39-2/h33,39,45H,3-32H2,1-2H3,(H,40,47)(H,41,46)(H,42,49)(H,43,48)(H,44,50).
What are the key properties of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide?
N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide has a molecular weight of 903.03 g/mol, XLogP of -4.63, 48 rotatable bonds, 7 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide is sourced from PubChem (CID 123667701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).